PDB: 97138 件ウェブページステータス検索Chemie searchBIRD

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5QND	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure H7_2) 分子名称: Thiol:disulfide interchange protein 著者 Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. 登録日 2019-01-27 公開日 2020-02-05 最終更新日 2020-07-22 実験手法 X-RAY DIFFRACTION (1.899 Å) 主引用文献 Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
2XOL	High resolution structure of TtrD from Archaeoglobus fulgidus 分子名称: 1,2-ETHANEDIOL, CHAPERONE PROTEIN TTRD 著者 Dawson, A, Coulthurst, S.J, Sargent, F, Hunter, W.N. 登録日 2010-08-18 公開日 2011-09-07 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.35 Å) 主引用文献 Conserved Signal Peptide Recognition Systems Across the Prokaryotic Domains. Biochemistry, 51, 2012
1BOZ	STRUCTURE-BASED DESIGN AND SYNTHESIS OF LIPOPHILIC 2,4-DIAMINO-6-SUBSTITUTED QUINAZOLINES AND THEIR EVALUATION AS INHIBITORS OF DIHYDROFOLATE REDUCTASE AND POTENTIAL ANTITUMOR AGENTS 分子名称: N6-(2,5-DIMETHOXY-BENZYL)-N6-METHYL-PYRIDO[2,3-D]PYRIMIDINE-2,4,6-TRIAMINE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, PROTEIN (DIHYDROFOLATE REDUCTASE) 著者 Gangjee, A, Vidwans, A.P, Vasudevan, A, Queener, S.F, Kisliuk, R.L, Cody, V, Li, R, Galitsky, N, Luft, J.R, Pangborn, W. 登録日 1998-08-06 公開日 1998-08-12 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structure-based design and synthesis of lipophilic 2,4-diamino-6-substituted quinazolines and their evaluation as inhibitors of dihydrofolate reductases and potential antitumor agents. J.Med.Chem., 41, 1998
5RAJ	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with BD009815a 分子名称: 2,4-dichloro-N-(pyridin-3-yl)benzamide, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.61 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
5RB1	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with FM001700a 分子名称: CHLORIDE ION, Lysine-specific demethylase 3B, MANGANESE (II) ION, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.76 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
1C7I	THERMOPHYLIC PNB ESTERASE 分子名称: CALCIUM ION, PROTEIN (PARA-NITROBENZYL ESTERASE) 著者 Spiller, B, Gershenson, A, Arnold, F, Stevens, R. 登録日 2000-02-21 公開日 2000-03-29 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 A structural view of evolutionary divergence. Proc.Natl.Acad.Sci.USA, 96, 1999
1C7J	PNB ESTERASE 56C8 分子名称: POTASSIUM ION, PROTEIN (PARA-NITROBENZYL ESTERASE), SULFATE ION 著者 Spiller, B, Gershenson, A, Arnold, F, Stevens, R.C. 登録日 2000-02-21 公開日 2000-03-29 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 A structural view of evolutionary divergence. Proc.Natl.Acad.Sci.USA, 96, 1999
2XQ9	Pentameric ligand gated ion channel GLIC mutant E221A in complex with tetraethylarsonium (TEAs) 分子名称: ARSENIC, GLR4197 PROTEIN 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.2 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
5RAK	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS040486b 分子名称: 3-(pyridin-3-yl)aniline, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.69 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
5RAX	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with FM010054a 分子名称: 2-(2-methoxyphenoxy)ethanehydrazide, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.01 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
2XQ8	Pentameric ligand gated ion channel GLIC in complex with zinc ion (Zn2+) 分子名称: GLR4197 PROTEIN, ZINC ION 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.6 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
5RAI	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS040404c 分子名称: (1-methyl-5-phenyl-pyrazol-3-yl)methanol, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.54 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
5RB3	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS039249d 分子名称: 1-methyl-3-(thiophen-2-yl)-1H-pyrazol-5-amine, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.53 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
1CCV	NMR SOLUTION STRUCTURE OF APIS MELLIFERA CHYMOTRYPSIN INHIBITOR (AMCI). 分子名称: CHYMOTRYPSIN INHIBITOR 著者 Cierpicki, T, Otlewski, J. 登録日 1999-03-02 公開日 1999-03-12 最終更新日 2023-12-27 実験手法 SOLUTION NMR 主引用文献 NMR solution structure of Apis mellifera chymotrypsin/cathepsin G inhibitor-1 (AMCI-1): structural similarity with Ascaris protease inhibitors Protein Sci., 9, 2000
1H8E	(ADP.AlF4)2(ADP.SO4) bovine F1-ATPase (all three catalytic sites occupied) 分子名称: ADENOSINE-5'-DIPHOSPHATE, BOVINE MITOCHONDRIAL F1-ATPASE, GLYCEROL, ... 著者 Menz, R.I, Walker, J.E, Leslie, A.G.W. 登録日 2001-02-02 公開日 2001-08-10 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Structure of Bovine Mitochondrial F1-ATPase with Nucleotide Bound to All Three Catalytic Sites: Implications for the Mechanism of Rotary Catalysis Cell(Cambridge,Mass.), 106, 2001
5RAL	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS039332c 分子名称: 5-azanyl-2-pyrrol-1-yl-benzenecarbonitrile, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
5RB2	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with FM001784a 分子名称: 2-methyl-1,3-benzoxazol-6-ol, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.52 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
5RAG	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with FM001767a 分子名称: CHLORIDE ION, Lysine-specific demethylase 3B, MANGANESE (II) ION, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.52 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
2XQ6	Pentameric ligand gated ion channel GLIC in complex with cesium ion (Cs+) 分子名称: CESIUM ION, GLR4197 PROTEIN 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.7 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
5RAW	PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with FM009970a 分子名称: 1-{4-[(2-methoxyethyl)amino]piperidin-1-yl}ethan-1-one, CHLORIDE ION, Lysine-specific demethylase 3B, ... 著者 Snee, M, Nowak, R, Johansson, C, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U. 登録日 2020-03-16 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 PanDDA analysis group deposition of Human JMJD1B screened against the DSPL Fragment Library To Be Published
2XQA	Pentameric ligand gated ion channel GLIC in complex with tetrabutylantimony (TBSb) 分子名称: ANTIMONY (III) ION, GLR4197 PROTEIN 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.7 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
2GVI	Crystal structure of a putative formylmethanofuran dehydrogenase subunit e (ta1109) from thermoplasma acidophilum at 1.87 A resolution 分子名称: 1,2-ETHANEDIOL, ACETIC ACID, UNKNOWN LIGAND, ... 著者 Joint Center for Structural Genomics (JCSG) 登録日 2006-05-02 公開日 2006-06-13 最終更新日 2023-01-25 実験手法 X-RAY DIFFRACTION (1.87 Å) 主引用文献 Structures of three members of Pfam PF02663 (FmdE) implicated in microbial methanogenesis reveal a conserved alpha+beta core domain and an auxiliary C-terminal treble-clef zinc finger. Acta Crystallogr.,Sect.F, 66, 2010
2XQ3	Pentameric ligand gated ion channel GLIC in complex with Br-lidocaine 分子名称: BROMIDE ION, GLR4197 PROTEIN 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.5 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
2XQ7	Pentameric ligand gated ion channel GLIC in complex with cadmium ion (Cd2+) 分子名称: CADMIUM ION, GLR4197 PROTEIN 著者 Hilf, R.J.C, Bertozzi, C, Zimmermann, I, Reiter, A, Trauner, D, Dutzler, R. 登録日 2010-09-01 公開日 2010-11-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.4 Å) 主引用文献 Structural Basis of Open Channel Block in a Prokaryotic Pentameric Ligand-Gated Ion Channel Nat.Struct.Mol.Biol., 17, 2010
2XBD	INTERNAL XYLAN BINDING DOMAIN FROM CELLULOMONAS FIMI XYLANASE D, NMR, MINIMIZED AVERAGE STRUCTURE 分子名称: XYLANASE D 著者 Simpson, P.J, Bolam, D.N, Cooper, A, Ciruela, A, Hazlewood, G.P, Gilbert, H.J, Williamson, M.P. 登録日 1998-10-27 公開日 1999-07-21 最終更新日 2022-03-16 実験手法 SOLUTION NMR 主引用文献 A family IIb xylan-binding domain has a similar secondary structure to a homologous family IIa cellulose-binding domain but different ligand specificity. Structure Fold.Des., 7, 1999

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